N-aminocarbonyl-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-3-methyl-butanamide

Systemtic Name: N-aminocarbonyl-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-3-methyl-butanamide Openeye Name: 2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-carbamoyl-3-methyl-butanamide CAS Name: 2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]-N-carbamoyl-3-methylbutanamide IUPAC Name: 2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanyl-N-carbamoyl-3-methylbutanamide Traditional Name: 2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]-N-carbamoyl-3-methyl-butyramide Formula: C17H25N5O4S2 MolecularWeight: 427.5415

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C17H25N5O4S2/c1-4-5-8-22-13-7-6-11(28(19,25)26)9-12(13)20-17(22)27-14(10(2)3)15(23)21-16(18)24/h6-7,9-10,14H,4-5,8H2,1-3H3,(H2,19,25,26)(H3,18,21,23,24)